admetshiny-package      admetshiny: Interactive ADMET and Drug-Likeness
                        Analysis
applyFilters            Apply drug-likeness filters in sequence
apply_palette           Apply a colour palette to a ggplot object
calcCDKDescriptors      Calculate molecular descriptors with CDK
computeADMETProperties
                        Compute BOILED-Egg ADMET properties
computeViolationColumns
                        Compute drug-likeness violation columns
eganFilter              Egan drug-likeness filter
generateReport          Generate an ADMETShiny report from the R
                        console
getSmilesFromIdentifiers
                        Retrieve canonical SMILES from PubChem
ghoseFilter             Ghose drug-likeness filter
lipinskiFilter          Lipinski Rule-of-Five filter
mapADMETColumns         Map user columns to standard ADMET schema
mapCDKDescriptors       Map CDK descriptors to the application's
                        standard schema
mueggeFilter            Muegge drug-likeness filter
palette_selector_ui     Colour palette selector UI element
plotBoiledEgg           BOILED-Egg plot
plotClusterHeatmap      Cluster heatmap with dendrogram
plotCorrHeatmap         Correlation heatmap of physicochemical
                        properties
plotHistogramCustom     Custom histogram
plotLogP                LogP distribution histogram
plotMW                  Molecular weight distribution histogram
plotPCA                 Principal Component Analysis (PCA) chemical
                        space plot
plotParallel            Parallel coordinates plot
plotRadar               Radar plot of physicochemical profile
plotTPSA                TPSA distribution histogram
plotTSNE                t-SNE chemical space plot
plotTanimoto            Tanimoto / AGNES structural similarity
                        dendrogram
plotUMAP                UMAP chemical space plot
plotViolin              Violin plot
run_app                 Launch the ADMETShiny application
veberFilter             Veber drug-likeness filter
